N-[2-(4-methylsulfanylphenyl)ethyl]-4-(5-pyrrolidin-1-ylsulfonylindol-1-yl)butanamide

Systemtic Name: N-[2-(4-methylsulfanylphenyl)ethyl]-4-(5-pyrrolidin-1-ylsulfonylindol-1-yl)butanamide Openeye Name: N-[2-(4-methylsulfanylphenyl)ethyl]-4-(5-pyrrolidin-1-ylsulfonylindol-1-yl)butanamide CAS Name: N-[2-[4-(methylthio)phenyl]ethyl]-4-[5-(1-pyrrolidinylsulfonyl)-1-indolyl]butanamide IUPAC Name: N-[2-(4-methylsulfanylphenyl)ethyl]-4-(5-pyrrolidin-1-ylsulfonylindol-1-yl)butanamide Traditional Name: N-[2-[4-(methylthio)phenyl]ethyl]-4-(5-pyrrolidinosulfonylindol-1-yl)butyramide Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)CCCN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)CCCN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H31N3O3S2/c1-32-22-8-6-20(7-9-22)12-14-26-25(29)5-4-15-27-18-13-21-19-23(10-11-24(21)27)33(30,31)28-16-2-3-17-28/h6-11,13,18-19H,2-5,12,14-17H2,1H3,(H,26,29)